Geometry & MOs

Info

ID:	251397
PubChem CID:	103103699
Reduced:	BrON4C11H17 (1)
Stoich.:	ABC4D11E17 (1)
Weight, g/mol:	258.01162
ΔH_f, kcal/mol:	-34.3
Dipole, Da:	2.05
IP(EA), eV:	-9.43(-0.62)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-[(6-bromopyrimidin-4-yl)-ethylamino]acetamide

Drug info:

PubChemData

Smile

CCN(CC(=O)N)C1=CC(=NC(=N1)C(C)C)Br

DOS

IR

Vibrations